Glycoside
GD071068
Name:
NoneFormula:
C15H19O9N3Smiles:
CC(=O)O[C@H]1[C@H](C)O[C@@H](n2ncc(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
O=c1cn[nH]c(=O)[nH]1Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | -1.36 | Num_rotatable_bonds: | 4 |
| MolWt: | 385.33 | Num_heavy_atoms: | 27 |
| TPSA: | 155.88 | NumAromaticRings: | 1 |
Unique Aglycone
AD07645
Formula: C3H3O2N3
Smiles:
O=c1cn[nH]c(=O)[nH]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 0 |
| MolWt: | 113.08 | Num_heavy_atoms: | 8 |
| TPSA: | 78.61 | NumAromaticRings: | 1 |
